1,2,3,4-Tetrahydro-4,6-Dihydroxy-2-Methyl-1-Isoquinolinecarboxylic Acid Isopentyl Ester
[CAS# 23824-29-5]

Identification

• Name: 1,2,3,4-Tetrahydro-4,6-Dihydroxy-2-Methyl-1-Isoquinolinecarboxylic Acid Isopentyl Ester
• Synonyms: Isopentyl 4,6-Dihydroxy-2-Methyl-3,4-Dihydro-1H-Isoquinoline-1-Carboxylate; 4,6-Dihydroxy-2-Methyl-3,4-Dihydro-1H-Isoquinoline-1-Carboxylic Acid Isopentyl Ester; 4,6-Dihydroxy-2-Methyl-3,4-Dihydro-1H-Isoquinoline-1-Carboxylic Acid Isoamyl Ester
• Molecular Formula: C₁₆H₂₃NO₄
• Molecular Weight: 293.36
• CAS Registry Number: 23824-29-5
• SMILES: C1=CC(=CC2=C1C(N(CC2O)C)C(OCCC(C)C)=O)O
• InChI: 1S/C16H23NO4/c1-10(2)6-7-21-16(20)15-12-5-4-11(18)8-13(12)14(19)9-17(15)3/h4-5,8,10,14-15,18-19H,6-7,9H2,1-3H3
• InChIKey: HELVHBUMENIROO-UHFFFAOYSA-N

Properties

• Density: 1.189g/cm³ (Cal.)
• Boiling point: 439.119°C at 760 mmHg (Cal.)
• Flash point: 219.371°C (Cal.)